Crystal structure of (1Z,2E)-cinnamaldehyde oxime

The title compound, C(9)H(9)NO, crystallized with two independent mol­ecules (A and B) in the asymmetric unit. The conformation of the two mol­ecules differs slightly with the phenyl ring in mol­ecule A, forming a dihedral angle of 15.38 (12)° with the oxime group (O—N=C), compared to the correspond...

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Autores principales: Bugenhagen, Bernhard, Al Soom, Nuha, Al Jasem, Yosef, Thiemann, Thies
Formato: Online Artículo Texto
Lenguaje:English
Publicado: International Union of Crystallography 2015
Materias:
Data Reports
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4719980/
https://www.ncbi.nlm.nih.gov/pubmed/26870499
http://dx.doi.org/10.1107/S2056989015023853
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author Bugenhagen, Bernhard
Al Soom, Nuha
Al Jasem, Yosef
Thiemann, Thies
author_facet Bugenhagen, Bernhard
Al Soom, Nuha
Al Jasem, Yosef
Thiemann, Thies
author_sort Bugenhagen, Bernhard
collection PubMed
description The title compound, C(9)H(9)NO, crystallized with two independent mol­ecules (A and B) in the asymmetric unit. The conformation of the two mol­ecules differs slightly with the phenyl ring in mol­ecule A, forming a dihedral angle of 15.38 (12)° with the oxime group (O—N=C), compared to the corresponding angle of 26.29 (11)° in mol­ecule B. In the crystal, the A and B mol­ecules are linked head-to-head by O—H⋯N hydrogen bonds, forming –A–B–A–B– zigzag chains along [010]. Within the chains and between neighbouring chains there are C—H⋯π inter­actions present, forming a three-dimensional structure.
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spelling pubmed-47199802016-02-11 Crystal structure of (1Z,2E)-cinnamaldehyde oxime Bugenhagen, Bernhard Al Soom, Nuha Al Jasem, Yosef Thiemann, Thies Acta Crystallogr E Crystallogr Commun Data Reports The title compound, C(9)H(9)NO, crystallized with two independent mol­ecules (A and B) in the asymmetric unit. The conformation of the two mol­ecules differs slightly with the phenyl ring in mol­ecule A, forming a dihedral angle of 15.38 (12)° with the oxime group (O—N=C), compared to the corresponding angle of 26.29 (11)° in mol­ecule B. In the crystal, the A and B mol­ecules are linked head-to-head by O—H⋯N hydrogen bonds, forming –A–B–A–B– zigzag chains along [010]. Within the chains and between neighbouring chains there are C—H⋯π inter­actions present, forming a three-dimensional structure. International Union of Crystallography 2015-12-16 /pmc/articles/PMC4719980/ /pubmed/26870499 http://dx.doi.org/10.1107/S2056989015023853 Text en © Bugenhagen et al. 2015 http://creativecommons.org/licenses/by/2.0/uk/ This is an open-access article distributed under the terms of the Creative Commons Attribution Licence, which permits unrestricted use, distribution, and reproduction in any medium, provided the original authors and source are cited.
spellingShingle Data Reports
Bugenhagen, Bernhard
Al Soom, Nuha
Al Jasem, Yosef
Thiemann, Thies
Crystal structure of (1Z,2E)-cinnamaldehyde oxime
title Crystal structure of (1Z,2E)-cinnamaldehyde oxime
title_full Crystal structure of (1Z,2E)-cinnamaldehyde oxime
title_fullStr Crystal structure of (1Z,2E)-cinnamaldehyde oxime
title_full_unstemmed Crystal structure of (1Z,2E)-cinnamaldehyde oxime
title_short Crystal structure of (1Z,2E)-cinnamaldehyde oxime
title_sort crystal structure of (1z,2e)-cinnamaldehyde oxime
topic Data Reports
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4719980/
https://www.ncbi.nlm.nih.gov/pubmed/26870499
http://dx.doi.org/10.1107/S2056989015023853
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